UCSF

ZINC04560569

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2005 17 No

Popular Name: 3-Allyl-5-methoxy-4-propoxy-benzaldehyde 3-Allyl-5-methoxy-4-propoxy-benz…

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CAS Numbers: 876709-19-2 , [876709-19-2]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.20 3.15 -8.09 0 3 0 35 234.295 7 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )